SCHEMBL4786341

SCHEMBL4786341

CCOC(=O)C(C)(C)Oc1ccc(CNCCOC)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.56
ABCB11 O95342 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
TSHR P16473 1/20 0.56
HTR2A P28223 1/20 0.56
PMP22 Q01453 1/20 0.56
FBP1 P09467 5/20 0.46
KDM4E B2RXH2 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 3/20 0.43
OPRK1 P41145 1/20 0.43
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
PPARD Q03181 1/20 0.40
MEN1 O00255 1/20 0.40
ATM Q13315 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3685389 0.87 PPARA (0.52) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL3679798 0.86 ABCB11 (0.57) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL6785236 0.86 L3MBTL1 (0.45) PPARAKDM4EL3MBTL1PPARGKMT2A
SCHEMBL3943535 0.85 PPARA (0.62) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL14290115 0.85 L3MBTL1 (0.44) PPARAABCB11CYP1A2CYP3A4TSHR
Hydrochloric Acid SCHEMBL11448538 0.84 PPARA (0.61) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL6780088 0.84 PPARA (0.57) PPARACYP1A2CYP3A4KDM4EPPARG
SCHEMBL8768094 0.84 PPARA (0.56) PPARAABCB11CYP1A2CYP3A4TSHR
Hydrochloric Acid SCHEMBL11449524 0.82 PPARA (0.58) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL4575602 0.82 PPARA (0.52) PPARAABCB11CYP1A2CYP3A4TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513796-B1 PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORP (US) 2008-02-13 EP disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators SMITHKLINE BEECHAM CORPORATION 2005-10-06 US disclosed
EP-1513796-A2 PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2005-03-16 EP disclosed
WO-2004000785-A2 PHENYLOXYALKANONIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-12-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators CEL, HPN, LIPA PPARA 54/4885ABCB11 18/4885CYP1A2 688/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.